2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-(1-phenylimidazol-2-yl)sulfanyl-pentanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-4-(1-phenylimidazol-2-yl)sulfanyl-pentanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(1-phenylimidazol-2-yl)sulfanyl-pentanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-[(1-phenyl-2-imidazolyl)thio]pentanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-4-(1-phenylimidazol-2-yl)sulfanylpentanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-4-[(1-phenylimidazol-2-yl)thio]valeronitrile Formula: C21H17N5OS MolecularWeight: 387.45758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(=C1NC2=CC=CC=C2N1)C#N)SC3=NC=CN3C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)C(=C1NC2=CC=CC=C2N1)C#N)SC3=NC=CN3C4=CC=CC=C4

InChI

InChI=1S/C21H17N5OS/c1-14(28-21-23-11-12-26(21)15-7-3-2-4-8-15)19(27)16(13-22)20-24-17-9-5-6-10-18(17)25-20/h2-12,14,24-25H,1H3